SCHEMBL27973463

SCHEMBL27973463

CN1c2ccccc2SC1NN

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 1/20 0.39
▸ BCHE P06276 3/20 0.34
▸ ACHE P22303 2/20 0.34
▸ ADRA2A P08913 2/20 0.34
▸ ADRA2B P18089 2/20 0.34
▸ ADRA2C P18825 2/20 0.34
▸ SLC6A2 P23975 2/20 0.34
▸ HTR2C P28335 2/20 0.34
▸ SLC6A4 P31645 2/20 0.34
▸ HTR2B P41595 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ CHRM3 P20309 1/20 0.34
▸ DRD3 P35462 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ NOX1 Q9Y5S8 1/20 0.34
▸ EGFR P00533 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ HTR2A P28223 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11590547 0.78 BCHE (0.37) MAOABCHEACHEALDH1A1SMN1; SMN2
SCHEMBL31571121 0.75 MAOA (0.43) MAOABCHEACHEADRA2AADRA2B
SCHEMBL8931214 0.75 MAOA (0.43) MAOABCHEACHEADRA2AADRA2B
SCHEMBL12264201 0.74 MAOA (0.46) MAOABCHEADRA2AADRA2BADRA2C
SCHEMBL16728889 0.72 MAOA (0.45) MAOABCHEADRA2AADRA2BADRA2C
SCHEMBL347425 0.72 MAOA (0.45) MAOABCHEADRA2AADRA2BADRA2C
SCHEMBL29814962 0.72 MAOA (0.45) MAOABCHEADRA2AADRA2BADRA2C
SCHEMBL28851031 0.71 MAOA (0.34) MAOABCHEACHEEGFRALDH1A1
SCHEMBL1412732 0.71 MAOA (0.43) MAOAADRA2AADRA2BADRA2CSLC6A2
SCHEMBL7138108 0.71 MAOA (0.43) MAOABCHEACHEADRA2AADRA2B

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104034822-A Method for measuring content of glyoxal in food contact paper product NINGBO ENTRY EXIT INSPECTION AND QUARANTINE BUREAU OF P R C 2014-09-10 — — CN disclosed
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